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MolNFT v1 · #175418 · protein + DNA

Crystal structure of SLX1-SLX4 in complex with 5'FLAP DNA

7CQ4 · DNA (5'-D(*GP*GP*AP*TP*TP*AP*CP*AP*AP*CP*AP*GP*AP*T)-3'): “Crystal structure of SLX1-SLX4 in complex with 5'FLAP DNA”. X-ray diffraction, 1 ligand (ZN), 6 pockets (best druggability 0.71). MolNFT v1 #175418 on GenesisL1: 3D…

PDB
7CQ4
Type
protein + DNA
Length
461 residues
Chains
5
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
DNA (5'-D(*GP*GP*AP*TP*TP*AP*CP*AP*AP*CP*AP*GP*AP*T)-3'); DNA…
EC
3.1.-.-
UniProt
A6ZLG6, A0A6A5PU22
Ligands
ZN
Pockets
6 · best druggability 0.71

Structure

x-ray diffraction · 5 distinct chains · 47% helix, 14% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
HDNA (5'-D(*GP*GP*AP*TP*TP*AP*CP*AP*AP*CP*AP*GP*AP*T)-3')dna14——
KDNA (5'-D(*AP*GP*GP*AP*CP*AP*TP*CP*TP*TP*TP*GP*CP*C)-3')dna14——
LDNA (27-mer)dna27——
AStructure-specific endonuclease subunit SLX1 (EC 3.1.-.-)protein29140% helix, 18% strandA6ZLG6
BSLX4 isoform 1protein11565% helix, 5% strandA0A6A5PU22

Ligands and binding sites

  • ZN · Zinc ion · metal · 2 copies · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

6 pockets found on a 1 Å grid, 3 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
18290.710.7771empty
21560.510.7930empty
31370.510.8021empty
4980.430.7914empty
5640.390.7918empty

Interfaces

8 interfaces between chains.

  • A–B · 1138 Ų buried · 9 hydrogen bonds · protein-protein
  • K–L · 697 Ų buried · 61 hydrogen bonds · nucleic-nucleic
  • H–L · 586 Ų buried · 50 hydrogen bonds · nucleic-nucleic
  • L–A · 408 Ų buried · 5 hydrogen bonds · protein-nucleic
  • L–B · 384 Ų buried · 11 hydrogen bonds · protein-nucleic

Compared structures

  • 7CQ4 · Crystal structure of Slx1-Slx4 in complex with 5'flap DNA · the same entry in another collection · chain H against H, TM-score 1.00
  • A6ZLG6 · AlphaFold monomer V2.0 prediction for structure-specific endonuclease subunit SLX1… · a predicted model of the same protein · chain A against A, TM-score 0.94

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